SCHEMBL20924334

SCHEMBL20924334

CCn1ccc(-c2cc3ccccc3n2-c2ccc(Cl)cc2)cc1=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 8/20 0.73
▸ KCNH2 Q12809 6/20 0.47
▸ HAO1 Q9UJM8 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ APP P05067 1/20 0.42
▸ MDM2 Q00987 1/20 0.39
▸ PTGS2 P35354 1/20 0.38
▸ PRMT5 O14744 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ MAT2A P31153 1/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ PI4KA P42356 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ PI4KB Q9UBF8 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ BIRC5 O15392 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16053697 0.84 AOC3 (1.00) AOC3KCNH2CYP1A2
SCHEMBL15353204 0.75 AOC3 (0.56) AOC3KCNH2HAO1ALDH1A1APP
SCHEMBL23024879 0.72 AOC3 (0.52) AOC3KCNH2HAO1ALDH1A1HPGD
SCHEMBL20924336 0.72 AOC3 (0.52) AOC3KCNH2KDM4EALDH1A1MDM2
SCHEMBL8308575 0.71 PTGS2 (0.68) HAO1PTGS2
SCHEMBL16053366 0.69 AOC3 (0.75) AOC3KCNH2
SCHEMBL13425022 0.67 HAO1 (0.62) AOC3KCNH2HAO1KDM4EALDH1A1
SCHEMBL5661209 0.66 PTGS2 (0.61) ALDH1A1APPPTGS2CYP1A2
SCHEMBL23505897 0.65 AOC3 (0.42) AOC3ALDH1A1PIK3CDPIK3CAPIK3CB
SCHEMBL4856109 0.65 HAO1 (0.47) AOC3KCNH2HAO1ALDH1A1APP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970260-B1 IMIDAZO[4,5-C]PYRIDINE AND PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS SSAO INHIBITORS PROXIMAGEN LLC (US) 2019-04-24 — — EP disclosed
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